N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-2-(4-chlorophenyl)carbonyl-benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-2-(4-chlorophenyl)carbonyl-benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-2-(4-chlorobenzoyl)benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-2-[(4-chlorophenyl)-oxomethyl]benzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-2-(4-chlorobenzoyl)benzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-2-(4-chlorobenzoyl)benzamide Formula: C21H23ClN3O3+ MolecularWeight: 400.87862

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)Cl)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)Cl)CC(=O)N

InChI

InChI=1S/C21H22ClN3O3/c22-15-7-5-14(6-8-15)20(27)17-3-1-2-4-18(17)21(28)24-16-9-11-25(12-10-16)13-19(23)26/h1-8,16H,9-13H2,(H2,23,26)(H,24,28)/p+1